1-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-N-phenethyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-N-phenethyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-(furan-2-carbonyl)-4-piperidyl]-N-phenethyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[2-furanyl(oxo)methyl]-4-piperidinyl]-N-phenethyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-(furan-2-carbonyl)piperidin-4-yl]-N-phenethylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[1-(2-furoyl)-4-piperidyl]-N-phenethyl-piperidin-1-ium-4-carboxamide Formula: C24H32N3O3+ MolecularWeight: 410.52918

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCCC2=CC=CC=C2)C3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCCC2=CC=CC=C2)C3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C24H31N3O3/c28-23(25-13-8-19-5-2-1-3-6-19)20-9-14-26(15-10-20)21-11-16-27(17-12-21)24(29)22-7-4-18-30-22/h1-7,18,20-21H,8-17H2,(H,25,28)/p+1